Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14566362 | 0.90 | MEN1 (0.30) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14566375 | 0.85 | GAA (0.34) | TSHRALDH1A1HDAC3HDAC4HDAC1 | |
| SCHEMBL14566355 | 0.83 | FDPS (0.32) | TSHRCYP3A4ALDH1A1MAPTHDAC3 | |
| SCHEMBL14566492 | 0.83 | MEN1 (0.33) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14566424 | 0.82 | KDM4E (0.36) | TSHRCYP3A4MAPT | |
| SCHEMBL21957514 | 0.81 | CES1 (0.37) | CES2CES1ALDH1A1HCAR2PTGS2 | |
| SCHEMBL14566422 | 0.81 | KDM4E (0.38) | TSHRCES2CYP3A4MAPT | |
| SCHEMBL14566351 | 0.80 | HDAC3 (0.34) | ALDH1A1HSD17B10HDAC3HDAC4HDAC1 | |
| SCHEMBL14566406 | 0.79 | MEN1 (0.33) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14566335 | 0.79 | ALDH1A1 (0.33) | TSHRCYP3A4HPGDALDH1A1HDAC3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007027248-A2 | 3', 5' - CYCLIC NUCLEOSIDE ANALOGUES FOR TREATMENT OF HCV | VALEANT RESEARCH & DEVELOPMENT (US) | 2007-03-08 | — | — | WO | disclosed |